NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 31 R 4.2839 8.1133 120.8569 55.8982 29.7481 175.7346 32 S 3.9408 8.3735 122.5663 60.6662 62.1433 174.4825 33 D 4.9336 8.4105 121.0961 54.2991 41.4221 177.1566 34 A 4.2341 7.7785 123.3327 53.3040 19.4913 179.2636 35 E 4.1121 7.5683 115.5334 58.8352 30.0294 176.7952 36 P 4.2061 0.0000 0.0000 64.1442 31.7851 177.2022 37 H 4.1280 7.4274 115.6604 55.9446 29.5813 174.1024 38 Y 4.6497 6.4307 114.1904 58.5111 40.0786 177.3930 39 L 3.9998 7.1143 121.7875 57.6916 41.9690 177.1188 40 P 4.3546 0.0000 0.0000 65.0287 31.3835 177.8277 41 Q 4.0226 7.8140 119.5970 58.7927 29.0011 177.5807 42 L 4.3126 8.4064 121.8691 56.8532 41.6917 179.3958 43 R 3.9185 7.7991 116.3051 59.2725 29.4089 179.1187 44 K 4.0316 7.9330 119.3686 59.4362 32.3480 178.9813 45 D 4.3031 7.8364 119.9510 57.3636 40.8425 178.4565 46 I 3.7753 7.9910 119.1157 63.8846 37.8826 177.9959 47 L 3.9580 7.6442 119.7368 57.9295 41.5205 179.2983 48 E 4.0351 8.1418 118.4340 59.1365 29.3681 179.4707 49 V 3.6619 8.4288 119.0456 66.3471 31.6064 178.2201 50 I 3.7785 8.3229 119.5472 64.2223 36.5993 178.1228 51 C 4.2326 7.6705 118.6976 62.4296 31.5646 175.2768 52 K 4.0517 8.5137 119.2570 59.1237 31.7018 177.9139 53 Y 4.4710 8.0579 114.0776 59.0455 39.2715 176.1834 54 V 4.0277 8.0371 123.0068 61.4968 33.9457 176.0788 55 Q 4.4020 8.3295 115.6198 55.2914 30.9330 172.6887 56 I 4.6948 8.1192 115.5213 59.3257 41.1318 174.0751 57 D 4.8927 8.2110 120.2599 52.0361 42.8341 176.1966 58 P 4.3389 0.0000 0.0000 65.7610 31.6361 178.2303 59 E 4.1847 8.0848 116.5921 58.2428 29.8186 177.3268 60 M 4.1793 7.8224 118.3318 56.2909 32.6701 175.6150 61 V 4.6790 7.2817 118.7651 61.8437 32.5686 175.9231 62 T 4.5246 8.8841 125.2328 62.8912 70.5737 174.0103 63 V 4.9233 8.0633 122.4523 61.3743 34.9353 174.6696 64 Q 4.6390 9.7788 126.3240 54.9017 31.8433 173.4266 65 L 5.0505 8.5782 124.2717 54.5108 42.8966 175.1469 66 E 4.8907 9.0165 119.7729 55.4047 34.5022 173.9393 67 Q 4.9786 8.4561 117.2872 55.0272 32.9569 174.3481 68 K 4.5705 8.4068 120.0919 53.7535 35.3689 176.5131 69 D 4.6758 8.1956 121.3831 52.4948 39.7156 176.6607 70 G 4.0199 7.8002 100.8255 45.1654 0.0000 171.5688 71 D 4.4257 8.5287 115.7515 55.5161 38.4252 173.5886 72 I 4.7903 7.4419 117.0042 59.7047 41.8229 175.4032 73 S 5.0669 8.5451 118.8068 57.3178 66.9758 174.9150 74 I 4.4316 8.7546 121.7614 60.4192 39.6695 172.8875 75 L 4.5566 8.3263 127.1802 54.3163 42.2101 174.9752 76 E 4.8808 9.4535 127.2046 54.5824 32.1164 175.4250 77 L 5.0706 8.1753 122.3204 54.2916 43.5053 175.3958 78 N 4.6977 9.0826 121.2868 52.4880 40.4957 174.5063 79 V 4.4924 8.2065 122.3514 61.2484 32.5061 173.9377 80 T 4.2313 8.7061 122.2224 62.5598 68.2211 173.9645 81 L 4.3566 8.2968 126.9264 52.9763 42.8880 175.7921 82 P 4.6263 0.0000 0.0000 61.4102 33.2975 174.8379 83 E 4.1662 8.4708 117.0127 57.9156 29.8249 176.0003 84 A 4.3525 7.6860 117.9581 52.6136 21.3441 174.5486 85 E 4.8286 8.0129 127.6925 56.9429 33.5152 178.0054 86 E 3.7073 8.4696 118.4338 58.2680 29.9124 176.2126 87 L 4.4326 7.2075 120.3859 53.7933 43.0807 176.3674 88 K 4.2067 8.4866 123.7855 56.6252 32.6290 175.9028 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 31 R 8.11 4.28 0.00 1.84 1.90 0.00 3.11 0.00 0.00 3.28 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.63 0.00 32 S 8.37 3.94 0.00 3.98 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 D 8.41 4.93 0.00 2.71 2.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 A 7.78 4.23 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 E 7.57 4.11 0.00 1.78 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.47 0.00 36 P 0.00 4.21 0.00 0.49 1.67 0.00 3.68 0.00 0.00 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.63 0.00 37 H 7.43 4.13 0.00 3.50 3.54 0.00 5.69 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 Y 6.43 4.65 0.00 3.27 3.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 L 7.11 4.00 0.00 1.31 1.59 0.94 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 40 P 0.00 4.35 0.00 2.23 2.22 0.00 3.52 0.00 0.00 3.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 2.12 0.00 41 Q 7.81 4.02 0.00 2.20 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.99 0.00 0.00 0.00 0.00 0.00 2.47 2.71 0.00 42 L 8.41 4.31 0.00 1.97 1.72 1.12 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 43 R 7.80 3.92 0.00 1.98 2.18 0.00 2.76 0.00 0.00 3.19 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.63 0.00 44 K 7.93 4.03 0.00 1.99 2.17 0.00 1.48 0.00 0.00 1.65 0.00 0.00 2.93 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.60 1.48 7.81 45 D 7.84 4.30 0.00 2.83 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 I 7.99 3.78 1.86 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.87 0.92 0.00 0.00 47 L 7.64 3.96 0.00 1.95 1.70 0.95 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 48 E 8.14 4.04 0.00 2.13 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.47 0.00 49 V 8.43 3.66 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.00 0.00 0.96 0.00 0.00 50 I 8.32 3.78 2.00 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.63 0.92 0.00 0.00 51 C 7.67 4.23 0.00 3.18 3.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 K 8.51 4.05 0.00 2.08 1.78 0.00 1.83 0.00 0.00 1.93 0.00 0.00 3.12 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.51 1.78 7.81 53 Y 8.06 4.47 0.00 2.86 3.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 V 8.04 4.03 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.71 0.00 0.00 1.03 0.00 0.00 55 Q 8.33 4.40 0.00 2.03 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.05 6.59 0.00 0.00 0.00 0.00 0.00 2.19 2.26 0.00 56 I 8.12 4.69 1.88 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.65 0.92 0.00 0.00 57 D 8.21 4.89 0.00 2.80 2.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 P 0.00 4.34 0.00 2.21 2.30 0.00 3.69 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 1.98 0.00 59 E 8.08 4.18 0.00 1.98 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.33 0.00 60 M 7.82 4.18 0.00 2.28 2.32 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.61 0.00 61 V 7.28 4.68 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.77 0.00 0.00 0.98 0.00 0.00 62 T 8.88 4.52 4.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 63 V 8.06 4.92 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.77 0.00 0.00 0.92 0.00 0.00 64 Q 9.78 4.64 0.00 2.03 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.86 0.00 0.00 0.00 0.00 0.00 2.36 2.45 0.00 65 L 8.58 5.05 0.00 1.65 1.68 0.90 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 66 E 9.02 4.89 0.00 1.94 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.45 0.00 67 Q 8.46 4.98 0.00 1.88 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.80 0.00 0.00 0.00 0.00 0.00 2.37 2.39 0.00 68 K 8.41 4.57 0.00 1.62 1.70 0.00 1.70 0.00 0.00 1.63 0.00 0.00 2.66 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.36 1.34 7.81 69 D 8.20 4.68 0.00 2.64 2.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 G 7.80 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 71 D 8.53 4.43 0.00 2.82 2.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 I 7.44 4.79 1.88 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.85 0.92 0.00 0.00 73 S 8.55 5.07 0.00 3.72 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 I 8.75 4.43 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.61 0.91 0.00 0.00 75 L 8.33 4.56 0.00 1.64 1.62 0.90 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 76 E 9.45 4.88 0.00 1.90 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.39 0.00 77 L 8.18 5.07 0.00 1.64 1.58 0.91 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 78 N 9.08 4.70 0.00 2.68 2.76 0.00 0.00 6.01 8.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 V 8.21 4.49 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.77 0.00 0.00 0.92 0.00 0.00 80 T 8.71 4.23 4.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 81 L 8.30 4.36 0.00 1.63 1.59 0.92 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 82 P 0.00 4.63 0.00 2.18 2.09 0.00 3.78 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.98 0.00 83 E 8.47 4.17 0.00 1.98 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.32 0.00 84 A 7.69 4.35 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 E 8.01 4.83 0.00 1.95 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.14 0.00 86 E 8.47 3.71 0.00 1.97 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.31 0.00 87 L 7.21 4.43 0.00 1.68 1.55 0.92 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 88 K 8.49 4.21 0.00 1.74 1.64 0.00 1.83 0.00 0.00 1.74 0.00 0.00 3.04 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.32 1.38 7.81